1-[4-(4-chloranylphenoxy)piperidin-1-yl]sulfonyl-3-oxidanyl-piperidine-3-carboxylic acid

Systemtic Name: 1-[4-(4-chloranylphenoxy)piperidin-1-yl]sulfonyl-3-oxidanyl-piperidine-3-carboxylic acid Openeye Name: 1-[[4-(4-chlorophenoxy)-1-piperidyl]sulfonyl]-3-hydroxy-piperidine-3-carboxylic acid CAS Name: 1-[[4-(4-chlorophenoxy)-1-piperidinyl]sulfonyl]-3-hydroxy-3-piperidinecarboxylic acid IUPAC Name: 1-[4-(4-chlorophenoxy)piperidin-1-yl]sulfonyl-3-hydroxypiperidine-3-carboxylic acid Traditional Name: 1-[4-(4-chlorophenoxy)piperidino]sulfonyl-3-hydroxy-nipecotic acid Formula: C17H23ClN2O6S MolecularWeight: 418.89232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)Cl)(C(=O)O)O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)Cl)(C(=O)O)O

InChI

InChI=1S/C17H23ClN2O6S/c18-13-2-4-14(5-3-13)26-15-6-10-19(11-7-15)27(24,25)20-9-1-8-17(23,12-20)16(21)22/h2-5,15,23H,1,6-12H2,(H,21,22)